Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DHFR | P00374 | 4/20 | 0.43 |
| ▸ | GART | P22102 | 6/20 | 0.43 |
| ▸ | FOLR1 | P15328 | 9/20 | 0.39 |
| ▸ | SLC46A1 | Q96NT5 | 6/20 | 0.38 |
| ▸ | SLC19A1 | P41440 | 4/20 | 0.38 |
| ▸ | FOLR2 | P14207 | 3/20 | 0.38 |
| ▸ | ATIC | P31939 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9439735 | 1.00 | DHFR (0.43) | DHFRGARTFOLR1SLC46A1SLC19A1 | |
| SCHEMBL9859650 | 0.93 | GART (0.42) | DHFRGARTFOLR1SLC46A1SLC19A1 | |
| SCHEMBL9859644 | 0.93 | GART (0.42) | DHFRGARTFOLR1SLC46A1SLC19A1 | |
| SCHEMBL8997237 | 0.87 | DHFR (0.50) | DHFRGARTATICKDM4EALDH1A1 | |
| SCHEMBL8997230 | 0.87 | DHFR (0.50) | DHFRGARTATICKDM4EALDH1A1 | |
| SCHEMBL9439570 | 0.85 | GART (0.58) | DHFRGARTFOLR1SLC46A1SLC19A1 | |
| SCHEMBL9439643 | 0.82 | KMT2A (0.55) | DHFRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9439648 | 0.82 | KMT2A (0.55) | DHFRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL9041638 | 0.80 | DHFR (0.48) | DHFRKDM4EALDH1A1HPGDHSD17B10 | |
| SCHEMBL8997160 | 0.80 | DHFR (0.48) | DHFRATICKDM4EALDH1A1HPGD |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5354754-A | Antitumor and -carcinogenic agents; treating human epidermoid carcinoma KB | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-10-11 | — | — | US | disclosed |